COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL008730
Chemical Name: methylN-{[4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidin-1-yl]carbonyl}-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)N1CC/C(=C/2\c3ccc(cc3CCc3c2nccc3)Cl)/CC1

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Molecular Weight: 500.06
Empirical Formula: C26H30ClN3O3S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 6.876
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 4

     

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